2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4,6-dithiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4,6-dithiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-4,6-bis(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(2,6-dichlorophenyl)methylthio]-4,6-dithiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-4,6-dithiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(2,6-dichlorobenzyl)thio]-4,6-bis(2-thienyl)nicotinonitrile Formula: C21H12Cl2N2S3 MolecularWeight: 459.43438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CS4)C#N)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CS4)C#N)Cl

InChI

InChI=1S/C21H12Cl2N2S3/c22-16-4-1-5-17(23)15(16)12-28-21-14(11-24)13(19-6-2-8-26-19)10-18(25-21)20-7-3-9-27-20/h1-10H,12H2